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1-Isocyanato-2,4-dimethoxybenzene(CAS: 84370-87-6)

1-Isocyanato-2,4-dimethoxybenzene
CAS Number

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Basic Information

Molecular Formula
C9H9NO3
Molecular Weight
179.17 g/mol

Physical Properties

Melting Point
30 °C (lit.)
Boiling Point
140 °C/11 mmHg(lit.)
Density
1.2822 (rough estimate)

Chemical Identifiers

SMILES
COc1ccc(N=C=O)c(OC)c1
InChIKey
WRAZHLRMDRTLOZ-UHFFFAOYSA-N

Database References

MDL Number
MFCD00002005
Beilstein Registry Number
1106649

FAQ

1-Isocyanato-2,4-dimethoxybenzene is a white crystalline solid with a molecular weight of approximately 252.22 g/mol. It has low solubility in water but good solubility in organic solvents like methanol and dichloromethane. This compound is moderately reactive, particularly towards nucleophiles, and it can undergo addition reactions and condensation reactions.
1-Isocyanato-2,4-dimethoxybenzene is typically synthesized via an aromatic nucleophilic substitution reaction. The synthesis involves the reaction of 2,4-dimethoxybenzoyl isocyanate with appropriate aromatic halides or esters in the presence of a base. The yield and selectivity can be controlled by the choice of reaction conditions and catalysts.
1-Isocyanato-2,4-dimethoxybenzene is used in various industries, including pharmaceuticals, where it serves as a precursor for the synthesis of certain drugs. It is also utilized in the production of polymers, where it can act as a monomer or a crosslinking agent. Additionally, it has applications in the development of sensors and semiconductors.
When handling 1-Isocyanato-2,4-dimethoxybenzene, appropriate personal protective equipment (PPE) should be worn, including gloves, goggles, and a lab coat. Operations should be performed in a well-ventilated environment or within a fume hood to minimize exposure to vapors. Spills should be cleaned up using appropriate absorbent materials, and the area should be thoroughly washed down. Refer to the Safety Data Sheet (SDS) for specific handling and disposal instructions.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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